2-[2-(4-chloro-2-nitrophenyl)diazen-1-yl]-3-oxo-N-phenylbutanamide

2-[2-(4-chloro-2-nitrophenyl)diazen-1-yl]-3-oxo-N-phenylbutanamide

CAS: 4106-76-7

Formula: C16H13ClN4O4

SMILES: CC(=O)C(N=NC1=CC=C(Cl)C=C1[N+]([O-])=O)C(=O)NC1=CC=CC=C1

IUPAC: 2-[2-(4-chloro-2-nitrophenyl)diazen-1-yl]-3-oxo-N-phenylbutanamide

InChI: InChI=1/C16H13ClN4O4/c1-10(22)15(16(23)18-12-5-3-2-4-6-12)20-19-13-8-7-11(17)9-14(13)21(24)25/h2-9,15H,1H3,(H,18,23)

Composition: C (53.27%), H (3.63%), Cl (9.83%), N (15.53%), O (17.74%)

Molar Mass: 360.75

Atom Count: 38

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	360.0625326
Formal Charge	0
FSP3	0.12
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
InChIKey	KBNQUAQMTGZQGJ-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	93.6
Topological Polar Surface Area	114.03
Polarizability	34.08
Ring Count	2
Rotatable Bond Count	6

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<7 Days	4106-76-7		$279.45$279.45